(2S)-N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-2-(cyclohexylamino)propanamide

Systemtic Name: (2S)-N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-2-(cyclohexylamino)propanamide Openeye Name: (2S)-N-(2-benzoyl-4-bromo-phenyl)-2-(cyclohexylamino)propanamide CAS Name: (2S)-N-(2-benzoyl-4-bromophenyl)-2-(cyclohexylamino)propanamide IUPAC Name: (2S)-N-(2-benzoyl-4-bromophenyl)-2-(cyclohexylamino)propanamide Traditional Name: (2S)-N-(2-benzoyl-4-bromo-phenyl)-2-(cyclohexylamino)propionamide Formula: C22H25BrN2O2 MolecularWeight: 429.3501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2)NC3CCCCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2)NC3CCCCC3

InChI

InChI=1S/C22H25BrN2O2/c1-15(24-18-10-6-3-7-11-18)22(27)25-20-13-12-17(23)14-19(20)21(26)16-8-4-2-5-9-16/h2,4-5,8-9,12-15,18,24H,3,6-7,10-11H2,1H3,(H,25,27)/t15-/m0/s1